Chem
J-GLOBAL ID：200907010918719224   Nikkaji number：J462.772E

14-Acethyltalatisamine

14-アセチルタラチサミン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C26H41NO6
Molecular formula furigana： C26-H41-N-O6
Molecular weight： 463.615
InChI： InChI=1S/C26H41NO6/c1-6-27-12-24(13-30-3)8-7-20(32-5)26-16-9-15-18(31-4)11-25(29,17(23(26)27)10-19(24)26)21(16)22(15)33-14(2)28/h15-23,29H,6-13H2,1-5H3/t15-,16-,17+,18+,19-,20+,21-,22+,23-,24+,25+,26-/m1/s1
InChI key： ZHYCSYOPFIUANO-LTPKDCRKSA-N
SMILES： CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC(=O)C)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14
Systematic name  (3)：
  • 20-エチル-1α,16β-ジメトキシ-4-(メトキシメチル)アコニタン-8,14α-ジオール14-アセタート
  • (1S,2R,3R,4S,5R,6S,8S,9S,10R,13S,16S,17R)-11-エチル-8-ヒドロキシ-6,16-ジメトキシ-13-(メトキシメチル)-11-アザヘキサシクロ[7.7.2.12,5.01,10.03,8.013,17]ノナデカン-4-イル アセタート
  • (1S,2R,3R,4S,5R,6S,8S,9S,10R,13S,16S,17R)-11-ethyl-8-hydroxy-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl acetate
Other name (3)：
  • 20-Ethyl-1α,16β-dimethoxy-4-(methoxymethyl)aconitane-8,14α-diol 14-acetate
  • 14-アセチルタラチサミン
  • 14-Acethyltalatisamine
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